Table 3.
Binding energy of potential active ingredients to target proteins.
| Potential active ingredients | Combined energy (kJ/mol) | ||||
|---|---|---|---|---|---|
| TP53 | NTPK1 | ESR1 | MCM2 | EGFR | |
| Taxifolin | -8.94 | -4.37 | -2.47 | -3.54 | -4.07 |
| Lucidumoside D_qt | -4.06 | -3.48 | -2.82 | -3.03 | -4.11 |
| Eriodictyol | -5.64 | -4.56 | -4.97 | -3.88 | -4.01 |
| Olitoriside_qt | -4.06 | -3.48 | -2.82 | -3.03 | -4.70 |
| Luteolin | -4.88 | -2.74 | -2.67 | -5.02 | -3.45 |
| Sesamin | -7.69 | -6.08 | -4.86 | -4.71 | -4.26 |
| Stigmasterol | -5.69 | -4.10 | -4.86 | -3.01 | -4.75 |
| Isorhamnetin | -4.60 | -4.80 | -2.88 | -4.21 | -3.54 |
| Isofucosterol | -3.60 | -4.11 | -4.73 | -5.26 | -3.54 |
| Matrine | -6.22 | -5.04 | -4.16 | -4.49 | -4.30 |
| Beta-sitosterol | -4.58 | -4.95 | -7.07 | -3.22 | -7.58 |
| Kaempferol | -7.39 | -4.52 | -4.06 | -3.68 | -6.01 |
| Quercetin | -8.74 | -3.61 | -3.10 | -2.29 | -3.16 |